6-Amino-14-hydroxy-18-(hydroxymethyl)-40-[2-(hydroxymethyl)-3-methyl-5-[7-(methylamino)-1,2,5,6,7,8-hexahydro-1,8-naphthyridin-4-yl]pent-2-enyl]-8-(3-hydroxyphenyl)-1,23-dimethyl-36,39-dioxa-5,24-diazadodecacyclo[29.16.4.238,42.13,7.111,25.010,15.012,35.015,19.025,34.027,32.038,40.046,52]pentapentaconta-3,7(55),26,28,42,44,46(52)-heptaen-21-yne-37,41,53-trione

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: 6-Amino-14-hydroxy-18-(hydroxymethyl)-40-[2-(hydroxymethyl)-3-methyl-5-[7-(methylamino)-1,2,5,6,7,8-hexahydro-1,8-naphthyridin-4-yl]pent-2-enyl]-8-(3-hydroxyphenyl)-1,23-dimethyl-36,39-dioxa-5,24-diazadodecacyclo[29.16.4.238,42.13,7.111,25.010,15.012,35.015,19.025,34.027,32.038,40.046,52]pentapentaconta-3,7(55),26,28,42,44,46(52)-heptaen-21-yne-37,41,53-trione
• 英文别名: 6-amino-14-hydroxy-18-(hydroxymethyl)-40-[2-(hydroxymethyl)-3-methyl-5-[7-(methylamino)-1,2,5,6,7,8-hexahydro-1,8-naphthyridin-4-yl]pent-2-enyl]-8-(3-hydroxyphenyl)-1,23-dimethyl-36,39-dioxa-5,24-diazadodecacyclo[29.16.4.238,42.13,7.111,25.010,15.012,35.015,19.025,34.027,32.038,40.046,52]pentapentaconta-3,7(55),26,28,42,44,46(52)-heptaen-21-yne-37,41,53-trione
• 化学式: C₇₆H₉₄N₆O₉
• 分子量: 1235.6
• InChiKey: CVQSRUJHKWUYQU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.3
• 重原子数：
  91
• 可旋转键数：
  9
• 环数：
  15.0
• sp3杂化的碳原子比例：
  0.59
• 拓扑面积：
  240
• 氢给体数：
  10
• 氢受体数：
  15